SCHEMBL11907589

SCHEMBL11907589

CC(=O)c1ccc(N2CCNCC2)c(NC(=O)c2nccnc2N)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 8/20 0.67
PIM3 Q86V86 8/20 0.67
PIM2 Q9P1W9 7/20 0.55
PRKCA P17252 1/20 0.46
GSK3B P49841 1/20 0.46
PRKCQ Q04759 1/20 0.46
PIK3CD O00329 2/20 0.44
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PRKCI P41743 3/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
ATM Q13315 1/20 0.42
VCP P55072 1/20 0.41
POLB P06746 1/20 0.41
ATR Q13535 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11908015 0.87 PIM1 (0.70) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11906947 0.87 PIM1 (0.64) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11984469 0.87 PIM1 (0.64) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11907693 0.87 PIM2 (0.54) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11907097 0.85 PIM1 (0.70) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11907344 0.83 PIM1 (0.78) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11907083 0.82 PIM1 (0.66) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11909771 0.82 PIM1 (0.68) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11907444 0.81 PIM2 (0.70) PIM1PIM3PIM2PRKCAGSK3B
SCHEMBL11906979 0.81 PIM1 (1.00) PIM1PIM3PIM2PRKCAGSK3B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.